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Ligand · J2D

J2D · N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]oxane-4-carboxamide

J2D, N-[(1R)-2-(hydroxyamino)-2-oxo-1-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)ethyl]oxane-4-carboxamide (C20 H19 F3 N2 O4, 408.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
J2D
Formula
C20 H19 F3 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

J2D in 2 structures; the first of them:

  • 6EAB · X-ray crystal structure of Pf-M1 in complex with inhibitor (6j) and catalytic zinc ion · J2D A1102 · binds LEU304, THR305, GLN317, GLU319, ALA320, ASN458, VAL459, GLY460 and 15 more
  • 6EAB · X-ray crystal structure of pf-M1 in complex with inhibitor (6J) and catalytic zinc ion · J2D A1102 · binds LEU304, THR305, GLN317, GLU319, ALA320, ASN458, VAL459, GLY460 and 15 more

Residues it binds most

GLU 2, MET 2, ALA 2, HIS 2, TYR 2, VAL 2, ARG 2, ASN 2, GLN 2, GLY 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion
  • PO4 · Phosphate ion
  • GOL · Glycerol

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